UCSF

ZINC38577307

Substance Information

In ZINC since Heavy atoms Benign functionality
January 27th, 2010 16 No

Download: MOL2 SDF SMILES Flexibase

Annotations

None

Vendors

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.27 0.63 -31.23 1 4 1 53 235.65 1
Hi High (pH 8-9.5) 2.27 -0.43 -17.95 0 4 0 52 234.642 1

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )